mFES - molecular Finite Element Solver
0.4
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Go to the source code of this file.
Functions | |
lGrid | createGrid (short) |
void | initGrid (lGrid) |
void | signDistanceGrid (lGrid, Molecule) |
void | signDistanceGridPR (lGrid, Molecule, float) |
void | setCoordinateGridPoint (GridPoint *, short, short, short) |
char | containsMoleculePR (Molecule, float, float, float, float) |
char | containsMolecule (Molecule, float, float, float) |
void | perturbMolecule (Molecule, float) |
void | signDistanceGridMol (lGrid, Molecule, double, int) |
void | shrink (lGrid, double, int) |
int | findProbesMol (lGrid, float) |
int | fastMarching (lGrid, char) |
char containsMolecule | ( | Molecule | , |
float | , | ||
float | , | ||
float | |||
) |
char containsMoleculePR | ( | Molecule | , |
float | , | ||
float | , | ||
float | , | ||
float | |||
) |
lGrid createGrid | ( | short | ) |
int fastMarching | ( | lGrid | , |
char | |||
) |
int findProbesMol | ( | lGrid | , |
float | |||
) |
void perturbMolecule | ( | Molecule | , |
float | |||
) |
void setCoordinateGridPoint | ( | GridPoint * | , |
short | , | ||
short | , | ||
short | |||
) |
void signDistanceGrid | ( | lGrid | , |
Molecule | |||
) |
void signDistanceGridMol | ( | lGrid | , |
Molecule | , | ||
double | , | ||
int | |||
) |
void signDistanceGridPR | ( | lGrid | , |
Molecule | , | ||
float | |||
) |